4-oxidanylidene-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-4-keto-phthalazine-1-carboxamide Formula: C24H28N4O5S MolecularWeight: 484.56792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)O

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)O

InChI

InChI=1S/C24H28N4O5S/c1-2-3-6-15-28-24(31)19-10-5-4-9-18(19)22(26-28)23(30)25-20-16-17(11-12-21(20)29)34(32,33)27-13-7-8-14-27/h4-5,9-12,16,29H,2-3,6-8,13-15H2,1H3,(H,25,30)